In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 19 | Yes |
Popular Name: (1S)-N'-(cyclohexylmethyl)-N,N-dimethyl-1-phenyl-ethane-1,2-diamine (1S)-N'-(cyclohexylmethyl)-N,N-d…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.65 | 10.39 | -130.48 | 3 | 2 | 2 | 21 | 262.441 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.65 | 6.82 | -1.22 | 1 | 2 | 0 | 15 | 260.425 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.65 | 8.3 | -40.19 | 2 | 2 | 1 | 20 | 261.433 | 6 | ↓ |